[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 1-oxidopyridin-1-ium-3-carboxylate
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[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 1-oxidopyridin-1-ium-3-carboxylate
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CAS No:
730255-25-1
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Formula:
C16H13N3O5
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Chemical Name:
[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 1-oxidopyridin-1-ium-3-carboxylate
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Synonyms:
MLS001005483;CHEMBL1546565;HMS2653N08;ZINC3297739;AKOS033631202;SMR000383971;Z18553541;3-{[2-oxo-2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-1-yl)ethoxy]carbonyl}pyridin-1-ium-1-olate;730255-25-1
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CAS No:
[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes
327.29 g/mol
327.08552052 g/mol
Computed Properties
Molecular Weight:327.29
XLogP3:-0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:327.08552052
Monoisotopic Mass:327.08552052
Topological Polar Surface Area:101
Heavy Atom Count:24
Complexity:512
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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